Vitas-M small molecule compound
(E)-{2-(2-ethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STK567212
SMILES CCOc1ccccc1C1/C(=C(/c2ccc(cc2)OC(C)C)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H36N2O6 MW 508.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N2O6/c1-4-36-24-9-6-5-8-23(24)26-25(27(32)21-10-12-22(13-11-21)37-20(2)3)28(33)29(34)31(26)15-7-14-30-16-18-35-19-17-30/h5-6,8-13,20,26,32H,4,7,14-19H2,1-3H3/b27-25+InChIKey
JTJYZBZDVKKVRF-IMVLJIQESA-NSynonyms
844826-14-8(4E)5(2ETHOXYPHENYL)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(2ethoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(4(propan2yloxy)phenyl)methanolate
(E)(2(2ETHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROPAN2YLOXYPHENYL)METHANOLATE
844826148
CCOC1=CC=CC=C1C2C(=C(C3=CC=C(C=C3)OC(C)C)O)C(=O)C(=O)N2CCCN4CCOCC4
CCOc1ccccc1C1C(=C(c2ccc(cc2)OC(C)C)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
InChI=1SC29H36N2O6c143624965823(24)2625(27(32)21101222(131121)3720(2)3)28(33)29(34)31(26)1571430161835191730h56813202632H471419H213H3b2725+
MFCD18245140
ZINC000009359340
ZINC000009359344
Check stock
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Check stock on Vitas-MAvailable files
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